- InChI
- InChI=1S/C4H9NO2/c1-3(2)7-4(5)6/h3H,1-2H3,(H2,5,6)
- InChI Key
- OVPLZYJGTGDFNB-UHFFFAOYSA-N
- Formula
- C4H9NO2
- SMILES
- CC(C)OC(N)=O
- Molecular Weight1
- 103.12
- CAS
- 1746-77-6
- Other Names
-
- Carbamic acid, isopropyl ester
- Isopropyl carbamate
- Isopropylester kyseliny karbaminove
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -187.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -342.18 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 10.58 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.91 | kJ/mol | Joback Calculated Property |
| log10WS | -0.88 | Crippen Calculated Property | |
| logPoct/wat | 0.490 | Crippen Calculated Property | |
| McVol | 84.640 | ml/mol | McGowan Calculated Property |
| Pc | 4498.26 | kPa | Joback Calculated Property |
| Tboil | 439.30 | K | Joback Calculated Property |
| Tc | 638.45 | K | Joback Calculated Property |
| Tfus | 275.26 | K | Joback Calculated Property |
| Vc | 0.306 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [172.46; 217.51] | J/mol×K | [439.30; 638.45] | 
|
| Cp,gas | 172.46 | J/mol×K | 439.30 | Joback Calculated Property |
| Cp,gas | 180.72 | J/mol×K | 472.49 | Joback Calculated Property |
| Cp,gas | 188.69 | J/mol×K | 505.68 | Joback Calculated Property |
| Cp,gas | 196.36 | J/mol×K | 538.88 | Joback Calculated Property |
| Cp,gas | 203.72 | J/mol×K | 572.07 | Joback Calculated Property |
| Cp,gas | 210.77 | J/mol×K | 605.26 | Joback Calculated Property |
| Cp,gas | 217.51 | J/mol×K | 638.45 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 454.20 | K | 94.80 | NIST |
Similar Compounds
Find more compounds similar to Carbamic acid, 1-methylethyl ester.
Sources
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